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Information card for entry 7047298
Preview
| Coordinates | 7047298.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C36 H32 Cu N3 O2 P2 |
|---|---|
| Calculated formula | C36 H32 Cu N3 O2 P2 |
| Title of publication | Nitric oxide-release study of a bio-inspired copper(i)-nitrito complex under chemical and biological conditions. |
| Authors of publication | Chuang, Wan-Jung; Narwane, Manmath; Chen, Hsing-Yin; Kao, Chai-Lin; Huang, Bin; Hsu, Kuang-Mei; Wang, Yun-Ming; Hsu, Sodio C. N. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2018 |
| Journal volume | 47 |
| Journal issue | 37 |
| Pages of publication | 13151 - 13157 |
| a | 11.56 ± 0.0012 Å |
| b | 18.1994 ± 0.0018 Å |
| c | 15.3888 ± 0.0015 Å |
| α | 90° |
| β | 102.919 ± 0.003° |
| γ | 90° |
| Cell volume | 3155.6 ± 0.5 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0613 |
| Residual factor for significantly intense reflections | 0.0403 |
| Weighted residual factors for significantly intense reflections | 0.1075 |
| Weighted residual factors for all reflections included in the refinement | 0.1279 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301850 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/04/ Each referenced PubChem compound corresponds to the full crystal structure. |
7047298.cif |
| 229292 | 2019-11-17 | cif/ Updating files of 7047296, 7047297, 7047298 Original log message: Adding full bibliography for 7047296--7047298.cif. |
7047298.cif |
| 210005 | 2018-08-21 | cif/ Adding structures of 7047296, 7047297, 7047298 via cif-deposit CGI script. |
7047298.cif |
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Users of the data should acknowledge the original authors of the
structural data.